SCHEMBL11680658

SCHEMBL11680658

CCOC(=O)C(C)c1cnccn1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.42
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
GAA P10253 1/20 0.42
CDC7 O00311 1/20 0.42
DBF4 Q9UBU7 1/20 0.42
RAB9A P51151 4/20 0.41
NPC1 O15118 3/20 0.41
GPR119 Q8TDV5 1/20 0.38
LMNA P02545 2/20 0.38
HPGD P15428 1/20 0.38
POLB P06746 3/20 0.38
TSHR P16473 2/20 0.38
TP53 P04637 1/20 0.38
NLRP3 Q96P20 2/20 0.37
ALDH1A1 P00352 1/20 0.37
KDM4E B2RXH2 1/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1433150 0.85 SMN1; SMN2 (0.43) SMN1; SMN2KMT2AMEN1GAACDC7
Methane SCHEMBL11679474 0.83 SMN1; SMN2 (0.42) SMN1; SMN2KMT2AMEN1GAACDC7
SCHEMBL14776438 0.83 HPGDS (0.41) SMN1; SMN2RAB9ANPC1LMNAPOLB
SCHEMBL4461793 0.82 SMN1; SMN2 (0.41) SMN1; SMN2KMT2AMEN1GAACDC7
Hydrochloric Acid SCHEMBL3972316 0.81 SMN1; SMN2 (0.40) SMN1; SMN2KMT2AMEN1GAACDC7
SCHEMBL9980434 0.79 GPR119 (0.39) SMN1; SMN2KMT2ARAB9ANPC1GPR119
SCHEMBL12877954 0.78 HPGDS (0.45)
SCHEMBL17765329 0.78 POLB (0.43) SMN1; SMN2KMT2AMEN1GAALMNA
SCHEMBL27557993 0.78 LMNA (0.44) SMN1; SMN2KMT2AGAARAB9ANPC1
SCHEMBL12862672 0.77 NLRP3 (0.41) SMN1; SMN2KMT2AMEN1GAACDC7

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109053742-B Novel tricyclic compounds ABBVIE 公司 2021-06-15 CN disclosed
US-4046763-A INTERMEDIATE FOR ULTRAVIOLET LIGHT ABSORBERS MCNEIL LABORATORIES, INCORPORATED (US) 1977-09-06 US disclosed